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Recent papers

Simulation of Raman and Raman optical activity of saccharides in solution
Physical Chemistry Chemical Physics 22 (4): 1983-1993 (2020).
Improved Cation Binding to Lipid Bilayers with Negatively Charged POPS by Effective Inclusion of Electronic Polarization
Journal of Chemical Theory and Computation 16 (1): 738-748 (2020).
Charge Scaling Manifesto: A Way of Reconciling the Inherently Macroscopic and Microscopic Natures of Molecular Simulations
B. J. Kirby
P. Jungwirth
Journal of Physical Chemistry Letters 10 (23): 7531-7536 (2019).
Quantifying the Strength of a Salt Bridge by Neutron Scattering and Molecular Dynamics
Journal of Physical Chemistry Letters 10 (12): 3254-3259 (2019).